0 mol 67 unq 0 iso 0 dist 9.67476 13.4853 8.64208 16.4721 8.8254 6.99398 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 5.04007 5.82571 6.87176 6.60395 7.08944 5.57389 numMergedOcc 0
2 mol 68 unq 1 iso 0 dist 7.81025 5.4779 6.87176 10.571 7.08944 5.57389 numMergedOcc 0
3 mol 68 unq 2 iso 0 dist 6.60395 5.82571 5.57389 5.04007 7.08944 6.87176 numMergedOcc 0
4 mol 75 unq 0 iso 0 dist 6.76977 6.54018 7.16583 11.6553 7.24623 7.118 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 8.08674 9.08836 4.83274 8.33694 10.5047 7.89214 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 8.33694 9.08836 7.89214 8.08674 10.5047 4.83274 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 5.2929 6.06993 8.93552 9.59458 9.38788 6.09472 numMergedOcc 0
8 mol 115 unq 1 iso 0 dist 5.2929 6.06993 8.93552 6.17589 7.12394 6.20658 numMergedOcc 0
9 mol 115 unq 2 iso 0 dist 5.2929 5.29965 8.35604 6.17589 7.12394 7.83568 numMergedOcc 0
10 mol 115 unq 3 iso 0 dist 6.17589 6.06993 6.20658 9.59458 5.54133 6.09472 numMergedOcc 0
11 mol 115 unq 4 iso 0 dist 6.17589 6.06993 6.20658 5.2929 7.12394 8.93552 numMergedOcc 0
12 mol 115 unq 5 iso 0 dist 6.17589 5.29965 7.83568 5.2929 7.12394 8.35604 numMergedOcc 0
13 mol 132 unq 0 iso 0 dist 8.97036 13.8837 6.495 19.7119 11.8902 6.2403 numMergedOcc 0
14 mol 132 unq 1 iso 0 dist 8.97036 14.8844 9.43748 19.7119 11.8902 8.34869 numMergedOcc 0
15 mol 281 unq 0 iso 0 dist 8.80931 11.2855 9.48968 13.8055 7.20467 9.64422 numMergedOcc 0
16 mol 281 unq 1 iso 0 dist 9.83857 7.12638 9.48968 9.53816 7.20467 9.64422 numMergedOcc 0
17 mol 281 unq 2 iso 0 dist 9.53816 7.12638 9.64422 9.83857 7.20467 9.48968 numMergedOcc 0
18 mol 281 unq 3 iso 0 dist 6.97131 10.7592 9.64422 10.7806 7.20467 9.48968 numMergedOcc 0
19 mol 284 unq 0 iso 0 dist 6.05336 8.82631 7.2795 11.8503 8.53089 7.35866 numMergedOcc 0
20 mol 284 unq 1 iso 0 dist 6.05336 13.559 9.41428 11.8503 8.53089 7.32482 numMergedOcc 0
21 mol 284 unq 2 iso 0 dist 6.05336 13.559 9.41428 19.0448 13.5143 8.08993 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 5.96033 6.94744 7.30618 13.3032 8.53973 9.22306 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 5.96033 6.94744 7.30618 13.3032 8.53973 9.22306 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 5.96033 6.94744 7.30618 13.3032 8.53973 9.22306 numMergedOcc 0
